Geometry & MOs

Info

ID:	275848
PubChem CID:	103818395
Reduced:	ClFNOH11C13 (1)
Stoich.:	ABCDE11F13 (1)
Weight, g/mol:	283.057548
ΔH_f, kcal/mol:	-57.37
Dipole, Da:	5.9
IP(EA), eV:	-8.72(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-5-fluoro-N-[(3-fluoro-4-methoxyphenyl)methyl]aniline

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CNC2=CC(=CC(=C2)Cl)F)O

DOS

IR

Vibrations